SCHEMBL11565405

SCHEMBL11565405

CCOC(=O)C(CCCCCCCOc1ccccc1)C(C)=O

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.76
L3MBTL1 Q9Y468 6/20 0.61
MAPK1 P28482 3/20 0.61
MAPT P10636 3/20 0.60
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
CRHBP P24387 1/20 0.57
CRHR2 Q13324 1/20 0.57
TSHR P16473 2/20 0.56
ALDH1A1 P00352 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46
RAB9A P51151 1/20 0.46
TP53 P04637 1/20 0.45
KCNA3 P22001 1/20 0.44
LTA4H P09960 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7636957 1.00 TDP1 (0.76) TDP1L3MBTL1MAPK1MAPTMEN1
SCHEMBL7644500 1.00 TDP1 (0.76) TDP1L3MBTL1MAPK1MAPTMEN1
SCHEMBL7638526 0.99 TDP1 (0.78) TDP1L3MBTL1MAPK1MAPTMEN1
SCHEMBL7638974 0.94 TDP1 (0.86) TDP1L3MBTL1MAPK1MAPTMEN1
SCHEMBL11022539 0.93 TDP1 (0.88) TDP1L3MBTL1MAPK1MAPTMEN1
SCHEMBL7571535 0.93 TDP1 (0.88) TDP1L3MBTL1MAPK1MAPTMEN1
SCHEMBL8080157 0.93 TDP1 (0.88) TDP1L3MBTL1MAPK1MAPTMEN1
SCHEMBL7429680 0.92 TDP1 (0.81) TDP1L3MBTL1MAPK1MAPTMEN1
SCHEMBL7429207 0.91 TDP1 (0.91) TDP1L3MBTL1MAPK1MAPTMEN1
SCHEMBL7434380 0.90 TDP1 (0.83) TDP1L3MBTL1MAPK1MAPTMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4171376-A Aryloxyalkyl keto-esters STERLING DRUG INC. (US) 1979-10-16 US disclosed